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Assay Detail

CHEMBL891766

Review assay metadata, readout intent, target linkage, and publication context from the same page.

Binding
Displacement of [N-methyl-3H]GW0438X from human PXR
12
Total Activities
12
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Intermediate

Target

Nuclear receptor subfamily 1 group I member 2 (CHEMBL3401)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Crystal structure of the PXR-T1317 complex provides a scaffold to examine the potential for receptor antagonism.
Xue Y, Chao E, Zuercher WJ, Willson TM, Collins JL, Redinbo MR.
Bioorg Med Chem (2007) 15 : 2156 -2166
PubMed 17215127 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 12 6.34 7.70

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL430006 1 7.70
CHEMBL396952 1 7.60
CHEMBL62136 T091317 1 7.40
CHEMBL242293 1 7.20
CHEMBL388024 1 6.60
CHEMBL242528 1 6.50
CHEMBL396953 1 6.20
CHEMBL242291 1 5.80
CHEMBL396041 1 5.60
CHEMBL242527 1 5.40
CHEMBL389979 1 5.10
CHEMBL242526 1 5.00

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL430006 IC50 = 19.95 nM 7.70
CHEMBL396952 IC50 = 25.12 nM 7.60
CHEMBL62136 T091317 IC50 = 39.81 nM 7.40
CHEMBL242293 IC50 = 63.1 nM 7.20
CHEMBL388024 IC50 = 251.19 nM 6.60
CHEMBL242528 IC50 = 316.23 nM 6.50
CHEMBL396953 IC50 = 630.96 nM 6.20
CHEMBL242291 IC50 = 1584.89 nM 5.80
CHEMBL396041 IC50 = 2511.89 nM 5.60
CHEMBL242527 IC50 = 3981.07 nM 5.40
CHEMBL389979 IC50 = 7943.28 nM 5.10
CHEMBL242526 IC50 = 10000.0 nM 5.00